AC1NX4QK
sodium 1-amino-4-(4-methyl-3-nitroanilino)-9,10-dioxoanthracene-2-sulfonate
Also Known As: EINECS 279-307-9|Sodium 1-amino-9,10-dihydro-4-((4-methyl-3-nitrophenyl)amino)-9,10-dioxoanthracene-2-sulphonate|sodium 1-amino-4-(4-methyl-3-nitroanilino)-9,10-dioxoanthracene-2-sulfonate|sodium 1-amino-4-[(4-methyl-3-nitrophenyl)amino]-9,10-dioxoanthracene-2-sulfonate|sodium,1-amino-4-(4-methyl-3-nitroanilino)-9,10-dioxoanthracene-2-sulfonate|2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[(4-methyl-3-nitrophenyl)amino]-9,10-dioxo-, monosodium salt|SODIUM 1-AMINO-9,10-DIHYDRO-4-[(4-METHYL-3-NITROPHENYL)AMINO]-9,10-DIOXOANTHRACENE-2-SULFONATE|Sodium 1-amino-9,10-dihydro-4-[(4-methyl-3-nitrophenyl)amino]-9,10-dioxoanthracene-2-sulphonate
| Molecular Formula | C21H14N3NaO7S |
|---|---|
| Molecular Weight | 475.045 g/mol |
| LogP | -0.08748 |
| Topological Polar Surface Area | 172.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 475.045 |
| Monoisotopic Mass | 475.045 |
| Heavy Atoms | 33 |
| Complexity | 1468.9203 |
Chemical Identifiers
| CAS Number | 79817-77-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)[O-])[N+](=O)[O-].[Na+] |
Product Overview
AC1NX4QK (CAS 79817-77-9), with molecular formula C21H14N3NaO7S and molecular weight 475.045 g/mol. IUPAC: sodium 1-amino-4-(4-methyl-3-nitroanilino)-9,10-dioxoanthracene-2-sulfonate.